2-(5-cyano-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)oxyethanoic acid

Systemtic Name: 2-(5-cyano-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)oxyethanoic acid Openeye Name: 2-(5-cyano-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)oxyacetic acid CAS Name: 2-[[5-cyano-6-(methylthio)-2-phenyl-4-pyrimidinyl]oxy]acetic acid IUPAC Name: 2-(5-cyano-6-methylsulfanyl-2-phenylpyrimidin-4-yl)oxyacetic acid Traditional Name: 2-[5-cyano-6-(methylthio)-2-phenyl-pyrimidin-4-yl]oxyacetic acid Formula: C14H11N3O3S MolecularWeight: 301.32044

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)OCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)OCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C14H11N3O3S/c1-21-14-10(7-15)13(20-8-11(18)19)16-12(17-14)9-5-3-2-4-6-9/h2-6H,8H2,1H3,(H,18,19)